Information card for entry 2238651

Structure parameters

• Chemical name: Poly[μ~5~-(4-methoxybenzenesulfonato)-sodium]
• Formula: C7 H7 Na O4 S
• Calculated formula: C7 H7 Na O4 S
• SMILES: S(=O)(=O)([O-])c1ccc(OC)cc1.[Na+]
• Title of publication: Poly[μ~5~-(4-methoxybenzenesulfonato)-sodium]
• Authors of publication: Chantrapromma, Suchada; Boonnak, Nawong; Fun, Hoong-Kun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 10
• Pages of publication: m558
• a: 8.3121 ± 0.0008 Å
• b: 6.0287 ± 0.0006 Å
• c: 35.93 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1800.5 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0375
• Residual factor for significantly intense reflections: 0.0369
• Weighted residual factors for significantly intense reflections: 0.1003
• Weighted residual factors for all reflections included in the refinement: 0.1007
• Goodness-of-fit parameter for all reflections included in the refinement: 1.202
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No